4-Nitrophenethyl bromide - CAS 5339-26-4
Catalog: |
BB028191 |
Product Name: |
4-Nitrophenethyl bromide |
CAS: |
5339-26-4 |
Synonyms: |
1-(2-bromoethyl)-4-nitrobenzene |
IUPAC Name: | 1-(2-bromoethyl)-4-nitrobenzene |
Description: | 4-Nitrophenethyl bromide (CAS# 5339-26-4 ) is a useful research chemical. |
Molecular Weight: | 230.06 |
Molecular Formula: | C8H8BrNO2 |
Canonical SMILES: | C1=CC(=CC=C1CCBr)[N+](=O)[O-] |
InChI: | InChI=1S/C8H8BrNO2/c9-6-5-7-1-3-8(4-2-7)10(11)12/h1-4H,5-6H2 |
InChI Key: | NTURQZFFJDCTMZ-UHFFFAOYSA-N |
Boiling Point: | 116 ℃ / 0.2 mmHg |
Purity: | 98 % |
Density: | 1.562 g/cm3 |
Appearance: | Yellowish adhering crystals or crystalline powder |
MDL: | MFCD00007386 |
LogP: | 3.05540 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112876474-A | Dimethoxy tetrahydroisoquinoline substituted purine derivative, preparation method thereof and application thereof in antitumor drugs | 20210118 |
CN-111647001-A | Fluorescent probe based on small molecule inhibitor and preparation method and application thereof | 20200615 |
WO-2021143924-A1 | Boric acid derivative | 20200119 |
KR-20210059663-A | Novel benzimidazole derivatives and its use | 20191115 |
WO-2021096314-A1 | Novel benzimidazole derivative and use thereof | 20191115 |
PMID | Publication Date | Title | Journal |
22081123 | 20111111 | Study of the reaction 2-(p-nitrophenyl)ethyl bromide + OH⁻ in dimeric micellar solutions | Molecules (Basel, Switzerland) |
20211594 | 20100501 | Molecular evolution of Theta-class glutathione transferase for enhanced activity with the anticancer drug 1,3-bis-(2-chloroethyl)-1-nitrosourea and other alkylating agents | Archives of biochemistry and biophysics |
15683365 | 20050515 | Residue 234 in glutathione transferase T1-1 plays a pivotal role in the catalytic activity and the selectivity against alternative substrates | The Biochemical journal |
12929383 | 20030107 | Resolution of the non-steady-state kinetics of the elimination of HBr from 2-(p-nitrophenyl)ethyl bromide in alcohol/alkoxide media | Organic & biomolecular chemistry |
12149122 | 20020801 | Characterization and physicochemical properties of a lipase from Pseudomonas mendocina 3121-1 | Biotechnology and applied biochemistry |
Complexity: | 150 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 228.97384 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 228.97384 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 45.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Nitrogen Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS